SCHEMBL24135367

SCHEMBL24135367

N#Cc1cn(-c2ccc(CN3CCNCC3)cn2)nc1CC(F)F

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 18/20 0.40
▸ KCNJ1 P48048 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24135363 0.87 RET (0.38) RETKCNJ1
SCHEMBL21850904 0.87 KCNJ1 (0.46) RETKCNJ1
SCHEMBL21850793 0.82 KCNJ1 (0.45) RETKCNJ1
SCHEMBL21851170 0.80 KCNJ1 (0.45) RETKCNJ1
SCHEMBL21850937 0.76 CXCR4 (0.40) RETKCNJ1
SCHEMBL24135318 0.76 KCNJ1 (0.43) RETKCNJ1
SCHEMBL24135381 0.74 RET (0.35) RETKCNJ1
SCHEMBL21850946 0.72 KCNJ1 (0.56) RETKCNJ1
SCHEMBL21851187 0.72 KCNJ1 (0.42) KCNJ1
SCHEMBL21850952 0.70 KCNJ1 (0.39) KCNJ1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3929194-A1 SUBSTITUTED NITROGEN CONTAINING COMPOUNDS Bristol-Myers Squibb Company (US) 2021-12-29 — — EP disclosed
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